2-(4-Methylphenyl)-2-oxoethyl thiocyanate structure

2-(4-Methylphenyl)-2-oxoethyl thiocyanate

[2-(4-methylphenyl)-2-oxoethyl] thiocyanate

Also Known As: 4-Methylphenacyl thiocyanate|2-(4-methylphenyl)-2-oxoethyl thiocyanate|2-Thiocyanato-1-(p-tolyl)ethanone|Maybridge1_003340|4-METHYLPHENACYLTHIOCYANATE|4-(Thiocyanatoacetyl)toluene|methylphenyloxoethylthiocyanate|2-Thiocyanato-1-p-tolylethanone|[2-(4-methylphenyl)-2-oxoethyl] thiocyanate|HMS550P18|9118AB|Thiocyanic acid 4-methylphenacyl ester|KA-0700|2-thiocyanato-1-(p-tolyl)ethan-1-one|KS-0000277K|1-(4-Methylphenyl)-2-thiocyanatoethanone|2-Thiocyanato-1-p-tolylethanone, AldrichCPR|2-(cyanosulfanyl)-1-(4-methylphenyl)ethan-1-one|2-(cyanosulfanyl)-1-(4-methylphenyl)ethanone|J1.352.378I|[2-(4-methylphenyl)-2-oxoethyl]thiocarbonitrile|Thiocyanic acid, 2-(4-methylphenyl)-2-oxoethyl ester

CAS: 6097-27-4
Molecular Formula C10H9NOS
Molecular Weight 191.04048 g/mol
LogP 2.392
Topological Polar Surface Area 40.86 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 3
Exact Mass 191.04048
Monoisotopic Mass 191.04048
Heavy Atoms 13
Complexity 336.93753

Chemical Identifiers

CAS Number 6097-27-4
SMILES CC1=CC=C(C=C1)C(=O)CSC#N

Product Overview

2-(4-Methylphenyl)-2-oxoethyl thiocyanate (CAS 6097-27-4), with molecular formula C10H9NOS and molecular weight 191.04048 g/mol. IUPAC: [2-(4-methylphenyl)-2-oxoethyl] thiocyanate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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